N-(3-morpholin-4-ylpropyl)-N-[1-(phenylmethyl)-4-(prop-2-enylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-N-[1-(phenylmethyl)-4-(prop-2-enylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[4-(allylcarbamoyl)-1-benzyl-4-piperidyl]-N-(3-morpholinopropyl)pyridine-3-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-N-[4-[oxo-(prop-2-enylamino)methyl]-1-(phenylmethyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[1-benzyl-4-(prop-2-enylcarbamoyl)piperidin-4-yl]-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide Traditional Name: N-[4-(allylcarbamoyl)-1-benzyl-4-piperidyl]-N-(3-morpholinopropyl)nicotinamide Formula: C29H39N5O3 MolecularWeight: 505.65166

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N(CCCN3CCOCC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C=CCNC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N(CCCN3CCOCC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C29H39N5O3/c1-2-13-31-28(36)29(11-17-33(18-12-29)24-25-8-4-3-5-9-25)34(27(35)26-10-6-14-30-23-26)16-7-15-32-19-21-37-22-20-32/h2-6,8-10,14,23H,1,7,11-13,15-22,24H2,(H,31,36)